Name: Name:2-(2,1,3-benzothiadiazol-4-yl)acetic acid
Brand: Angene
SKU: AG01DWFI
Rating: 90 (10 reviews)

2-(2,1,3-benzothiadiazol-4-yl)acetic acid

CAS No.:

42816-77-3

Catalog Number:

AG01DWFI

Molecular Formula:

C8H6N2O2S

Molecular Weight:

194.2104

Catalog Number:

AG01DWFI

Chemical Name:

2-(2,1,3-benzothiadiazol-4-yl)acetic acid

CAS Number:

42816-77-3

Molecular Formula:

C8H6N2O2S

Molecular Weight:

194.2104

MDL Number:

MFCD01104907

IUPAC Name:

2-(2,1,3-benzothiadiazol-4-yl)acetic acid

InChI:

InChI=1S/C8H6N2O2S/c11-7(12)4-5-2-1-3-6-8(5)10-13-9-6/h1-3H,4H2,(H,11,12)

InChI Key:

JUOHNWGCIDUACA-UHFFFAOYSA-N

SMILES:

OC(=O)Cc1cccc2c1nsn2

Complexity:

212

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

194.015g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

194.208g/mol

Monoisotopic Mass:

194.015g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

91.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.3